4-propan-2-yl-1,2-dihydropyridazine

C7H12N2 — CID 59945715

IUPAC4-propan-2-yl-1,2-dihydropyridazine
SMILESCC(C)C1=CNNC=C1
InChIInChI=1S/C7H12N2/c1-6(2)7-3-4-8-9-5-7/h3-6,8-9H,1-2H3
InChIKeyXKEIAKRSSSSQGA-UHFFFAOYSA-N
MW124.19 g/mol
LogP1.15
Rot. Bonds1

About 4-propan-2-yl-1,2-dihydropyridazine

4-propan-2-yl-1,2-dihydropyridazine (PubChem CID 59945715) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 4-propan-2-yl-1,2-dihydropyridazine.

Molecular Properties

Compound Name4-propan-2-yl-1,2-dihydropyridazine
PubChem CID59945715
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name4-propan-2-yl-1,2-dihydropyridazine
SMILESCC(C)C1=CNNC=C1
InChIInChI=1S/C7H12N2/c1-6(2)7-3-4-8-9-5-7/h3-6,8-9H,1-2H3
InChIKeyXKEIAKRSSSSQGA-UHFFFAOYSA-N
XLogP1.15
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-1,2-dihydropyridazine?
The IUPAC name of 4-propan-2-yl-1,2-dihydropyridazine (CID 59945715) is 4-propan-2-yl-1,2-dihydropyridazine.
What is the SMILES notation for 4-propan-2-yl-1,2-dihydropyridazine?
The canonical SMILES for 4-propan-2-yl-1,2-dihydropyridazine is CC(C)C1=CNNC=C1.
What is the InChIKey of 4-propan-2-yl-1,2-dihydropyridazine?
The InChIKey is XKEIAKRSSSSQGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-6(2)7-3-4-8-9-5-7/h3-6,8-9H,1-2H3.
What are the key properties of 4-propan-2-yl-1,2-dihydropyridazine?
4-propan-2-yl-1,2-dihydropyridazine has a molecular weight of 124.19 g/mol, XLogP of 1.15, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-1,2-dihydropyridazine is sourced from PubChem (CID 59945715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).